1-[(E)-(6-fluoranyl-2,3-dihydrothiochromen-4-ylidene)amino]-3-prop-2-enyl-thiourea

Systemtic Name: 1-[(E)-(6-fluoranyl-2,3-dihydrothiochromen-4-ylidene)amino]-3-prop-2-enyl-thiourea Openeye Name: 1-allyl-3-[(E)-(6-fluorothiochroman-4-ylidene)amino]thiourea CAS Name: 1-[(E)-(6-fluoro-2,3-dihydro-1-benzothiopyran-4-ylidene)amino]-3-prop-2-enylthiourea IUPAC Name: 1-[(E)-(6-fluoro-2,3-dihydrothiochromen-4-ylidene)amino]-3-prop-2-enylthiourea Traditional Name: 1-allyl-3-[(E)-(6-fluorothiochroman-4-ylidene)amino]thiourea Formula: C13H14FN3S2 MolecularWeight: 295.398763

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=S)NN=C1CCSC2=C1C=C(C=C2)F

Isomeric SMILES

C=CCNC(=S)N/N=C/1\CCSC2=C1C=C(C=C2)F

InChI

InChI=1S/C13H14FN3S2/c1-2-6-15-13(18)17-16-11-5-7-19-12-4-3-9(14)8-10(11)12/h2-4,8H,1,5-7H2,(H2,15,17,18)/b16-11+